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SN-35210 (free base)

CAT: 0804-HY-167885Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-167885Size:1 Each
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Description
SN-35210 free base, an ester analogue, is designed for rapid offset via esterase-mediated hydrolysis[1].
CAS Number
1450615-41-4
UNSPSC
12352005
Target
IGluR
Type
Natural Products
Related Pathways
Membrane Transporter/Ion Channel; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/sn-35210-free-base.html
Smiles
O=C(CCCCNC1(C2=C(Cl)C=CC=C2)C(CCCC1)=O)OC
Molecular Formula
C18H24ClNO3
Molecular Weight
337.84
References & Citations
[1]Martyn Harvey, et al. Determination of the Hypnotic Potency in Rats of the Novel Ketamine Ester Analogue SN 35210. Pharmacology. 2015;96 (5-6) :226-32.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

DS5Kfj4488
CAS Number1450615-41-4
PubChem CID71769517
IUPAC Namemethyl 5-[[1-(2-chlorophenyl)-2-oxocyclohexyl]amino]pentanoate
Molecular FormulaC18H24ClNO3
Molecular Weight337.8
XLogP2.7
Topological Polar Surface Area55.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count23
Formal Charge0
Complexity415
SMILES
COC(=O)CCCCNC1(CCCCC1=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C18H24ClNO3/c1-23-17(22)11-5-7-13-20-18(12-6-4-10-16(18)21)14-8-2-3-9-15(14)19/h2-3,8-9,20H,4-7,10-13H2,1H3
InChIKey
QFFBIIVCZDWTKZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of DS5Kfj4488
CAS: 1450615-41-4
CID: 71769517
Formula: C18H24ClNO3
MW: 337.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight337.8
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass337.1444713
Monoisotopic Mass337.1444713
Topological Polar Surface Area55.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity415
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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